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arXiv 2205.03045quant-ph
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无约束黑箱二进制优化的变分量子算法:在特征选择中的应用

Variational quantum algorithm for unconstrained black box binary optimization: Application to feature selection

Christa Zoufal, Ryan V. Mishmash, Nitin Sharma, Niraj Kumar, Aashish Sheshadri, Amol Deshmukh, Noelle Ibrahim, Julien Gacon, Stefan Woerner

摘要:

我们引入了一种变分量子算法来求解无约束黑箱二进制优化问题,即,目标函数为黑箱的问题。这与用于优化的量子算法的典型设置形成对比,其中经典目标函数被提供为给定的二次无约束二元优化问题并映射到泡利算子的总和。此外,我们基于量子虚时演化的收敛保证为我们的方法提供了理论依据。为了研究我们的算法的性能及其潜在的优势,我们解决了一个具有挑战性的现实世界的优化问题:特征选择。这指的是选择相关特征的子集以用于构建预测模型(例如欺诈检测)的问题。最优特征选择--当用通用损失函数来表述时--提供了很少的结构来构建经典的特征选择,从而主要导致了“贪婪方法”。这为(近期)量子算法与经典的最先进方法竞争留下了空间。我们应用我们的基于量子优化的特征选择算法,称为VarQFS,建立一个预测模型的信用风险数据集与20和59个输入功能(量子位)和训练模型,分别使用量子硬件和张量网络的数值模拟。我们表明,量子方法产生的竞争力,在某些方面甚至更好的性能相比,传统的特征选择技术在今天的行业。

英文摘要:

We introduce a variational quantum algorithm to solve unconstrained black box binary optimization problems, i.e., problems in which the objective function is given as black box. This is in contrast to the typical setting of quantum algorithms for optimization where a classical objective function is provided as a given Quadratic Unconstrained Binary Optimization problem and mapped to a sum of Pauli operators. Furthermore, we provide theoretical justification for our method based on convergence guarantees of quantum imaginary time evolution. To investigate the performance of our algorithm and its potential advantages, we tackle a challenging real-world optimization problem: feature selection. This refers to the problem of selecting a subset of relevant features to use for constructing a predictive model such as fraud detection. Optimal feature selection -- when formulated in terms of a generic loss function -- offers little structure on which to build classical heuristics, thus resulting primarily in 'greedy methods'. This leaves room for (near-term) quantum algorithms to be competitive to classical state-of-the-art approaches. We apply our quantum-optimization-based feature selection algorithm, termed VarQFS, to build a predictive model for a credit risk data set with 20 and 59 input features (qubits) and train the model using quantum hardware and tensor-network-based numerical simulations, respectively. We show that the quantum method produces competitive and in certain aspects even better performance compared to traditional feature selection techniques used in today's industry.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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